2-(2-diethylaminoethyl)-3H-isoindol-2-ium-1-amine

Systemtic Name: 2-(2-diethylaminoethyl)-3H-isoindol-2-ium-1-amine Openeye Name: 2-(2-diethylaminoethyl)-3H-isoindol-2-ium-1-amine CAS Name: 2-(2-diethylaminoethyl)-3H-isoindol-2-ium-1-amine IUPAC Name: 2-(2-diethylaminoethyl)-3H-isoindol-2-ium-1-amine Traditional Name: 2-(3-amino-1H-isoindol-2-ium-2-yl)ethyl-diethyl-amine Formula: C14H22N3+ MolecularWeight: 232.34458

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[N+]1=C(C2=CC=CC=C2C1)N

Isomeric SMILES

CCN(CC)CC[N+]1=C(C2=CC=CC=C2C1)N

InChI

InChI=1S/C14H21N3/c1-3-16(4-2)9-10-17-11-12-7-5-6-8-13(12)14(17)15/h5-8,15H,3-4,9-11H2,1-2H3/p+1